4-(4-cyclopropylphenyl)-3-propylpiperidine

C17H25N — CID 79978393

IUPAC4-(4-cyclopropylphenyl)-3-propylpiperidine
SMILESCCCC1CNCCC1c1ccc(C2CC2)cc1
InChIInChI=1S/C17H25N/c1-2-3-16-12-18-11-10-17(16)15-8-6-14(7-9-15)13-4-5-13/h6-9,13,16-18H,2-5,10-12H2,1H3
InChIKeyBBBZMENUNJOTQT-UHFFFAOYSA-N
MW243.39 g/mol
LogP4.06
Rot. Bonds4

About 4-(4-cyclopropylphenyl)-3-propylpiperidine

4-(4-cyclopropylphenyl)-3-propylpiperidine (PubChem CID 79978393) has the molecular formula C17H25N and a molecular weight of 243.39 g/mol. Its IUPAC name is 4-(4-cyclopropylphenyl)-3-propylpiperidine.

Molecular Properties

Compound Name4-(4-cyclopropylphenyl)-3-propylpiperidine
PubChem CID79978393
Molecular FormulaC17H25N
Molecular Weight243.39 g/mol
Exact Mass243.20
IUPAC Name4-(4-cyclopropylphenyl)-3-propylpiperidine
SMILESCCCC1CNCCC1c1ccc(C2CC2)cc1
InChIInChI=1S/C17H25N/c1-2-3-16-12-18-11-10-17(16)15-8-6-14(7-9-15)13-4-5-13/h6-9,13,16-18H,2-5,10-12H2,1H3
InChIKeyBBBZMENUNJOTQT-UHFFFAOYSA-N
XLogP4.06
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(4-phenylphenyl)-3-propylpiperidine
CID 79310826
3-propyl-4-[4-(trifluoromethyl)phenyl]piperidine
CID 79320434
2-methyl-5-(3-propylpiperidin-4-yl)pyridine
CID 104824038
4-(4-bromo-3-methylphenyl)-3-propylpiperidine
CID 79321007
4-(3-chlorophenyl)-3-propylpiperidine
CID 79321401
2-methoxy-5-(3-propylpiperidin-4-yl)pyridine
CID 114938886
4-(4-cyclopropylphenyl)-3-methylpiperidine
CID 79978066
(3R,4S)-3-(4-methylphenyl)-4-propylpyrrolidine
CID 124562401
3-ethyl-4-phenylpiperidine
CID 56828112
4-(3-bromothiophen-2-yl)-3-propylpiperidine
CID 115381531
4-(2,3-dichlorophenyl)-3-propylpiperidine
CID 79320625
4-(2-chloro-6-fluorophenyl)-3-propylpiperidine
CID 79320231

Frequently Asked Questions

What is the IUPAC name of 4-(4-cyclopropylphenyl)-3-propylpiperidine?
The IUPAC name of 4-(4-cyclopropylphenyl)-3-propylpiperidine (CID 79978393) is 4-(4-cyclopropylphenyl)-3-propylpiperidine.
What is the SMILES notation for 4-(4-cyclopropylphenyl)-3-propylpiperidine?
The canonical SMILES for 4-(4-cyclopropylphenyl)-3-propylpiperidine is CCCC1CNCCC1c1ccc(C2CC2)cc1.
What is the InChIKey of 4-(4-cyclopropylphenyl)-3-propylpiperidine?
The InChIKey is BBBZMENUNJOTQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N/c1-2-3-16-12-18-11-10-17(16)15-8-6-14(7-9-15)13-4-5-13/h6-9,13,16-18H,2-5,10-12H2,1H3.
What are the key properties of 4-(4-cyclopropylphenyl)-3-propylpiperidine?
4-(4-cyclopropylphenyl)-3-propylpiperidine has a molecular weight of 243.39 g/mol, XLogP of 4.06, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-cyclopropylphenyl)-3-propylpiperidine is sourced from PubChem (CID 79978393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).